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Information card for entry 1566140
Preview
| Coordinates | 1566140.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C32 H36 B2 O6 |
|---|---|
| Calculated formula | C32 H36 B2 O6 |
| Title of publication | 1,8,10-Trisubstituted anthracenyl hydrocarbons: Towards versatile scaffolds for multiple-H-bonded recognition arrays |
| Authors of publication | Forensi, Silvia; Stopin, Antoine; de Leo, Federica; Wouters, Johan; Bonifazi, Davide |
| Journal of publication | Tetrahedron |
| Year of publication | 2020 |
| Journal volume | 76 |
| Journal issue | 51 |
| Pages of publication | 131299 |
| a | 12.5963 ± 0.0003 Å |
| b | 14.7352 ± 0.0004 Å |
| c | 16.1555 ± 0.0005 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 2998.61 ± 0.14 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 62 |
| Hermann-Mauguin space group symbol | P n m a |
| Hall space group symbol | -P 2ac 2n |
| Residual factor for all reflections | 0.1226 |
| Residual factor for significantly intense reflections | 0.0941 |
| Weighted residual factors for significantly intense reflections | 0.2729 |
| Weighted residual factors for all reflections included in the refinement | 0.2939 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.038 |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 272250 (current) | 2022-01-26 | cif/ Adding structures of 1566137, 1566138, 1566139, 1566140, 1566141, 1566142, 1566143, 1566144, 1566145, 1566146 via cif-deposit CGI script. |
1566140.cif |
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Users of the data should acknowledge the original authors of the
structural data.